[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone

C32H24Cl2N6O3 — CID 78320319

IUPAC[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2nc(-c3cccc4c3ccn4C(=O)c3ccc(Cl)cc3Cl)cn3ccnc23)cc1)N1CCOCC1
InChIInChI=1S/C32H24Cl2N6O3/c33-21-6-9-25(26(34)18-21)32(42)40-12-10-24-23(2-1-3-28(24)40)27-19-39-13-11-35-30(39)29(37-27)36-22-7-4-20(5-8-22)31(41)38-14-16-43-17-15-38/h1-13,18-19H,14-17H2,(H,36,37)
InChIKeyLYFHBQPWBHJZNE-UHFFFAOYSA-N
MW611.49 g/mol
LogP6.56
Rot. Bonds5

About [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone

[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone (PubChem CID 78320319) has the molecular formula C32H24Cl2N6O3 and a molecular weight of 611.49 g/mol. Its IUPAC name is [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone
PubChem CID78320319
Molecular FormulaC32H24Cl2N6O3
Molecular Weight611.49 g/mol
Exact Mass610.13
IUPAC Name[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2nc(-c3cccc4c3ccn4C(=O)c3ccc(Cl)cc3Cl)cn3ccnc23)cc1)N1CCOCC1
InChIInChI=1S/C32H24Cl2N6O3/c33-21-6-9-25(26(34)18-21)32(42)40-12-10-24-23(2-1-3-28(24)40)27-19-39-13-11-35-30(39)29(37-27)36-22-7-4-20(5-8-22)31(41)38-14-16-43-17-15-38/h1-13,18-19H,14-17H2,(H,36,37)
InChIKeyLYFHBQPWBHJZNE-UHFFFAOYSA-N
XLogP6.56
TPSA93.76 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500611.49
LogP ≤ 56.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone?
The IUPAC name of [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone (CID 78320319) is [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone is O=C(c1ccc(Nc2nc(-c3cccc4c3ccn4C(=O)c3ccc(Cl)cc3Cl)cn3ccnc23)cc1)N1CCOCC1.
What is the InChIKey of [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone?
The InChIKey is LYFHBQPWBHJZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24Cl2N6O3/c33-21-6-9-25(26(34)18-21)32(42)40-12-10-24-23(2-1-3-28(24)40)27-19-39-13-11-35-30(39)29(37-27)36-22-7-4-20(5-8-22)31(41)38-14-16-43-17-15-38/h1-13,18-19H,14-17H2,(H,36,37).
What are the key properties of [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone?
[4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone has a molecular weight of 611.49 g/mol, XLogP of 6.56, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[6-[1-(2,4-dichlorobenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 78320319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).